SCHEMBL5250951

SCHEMBL5250951

CCCCC(C(=O)O)C(C)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.50
MAPK1 P28482 1/20 0.50
GPR84 Q9NQS5 7/20 0.48
FFAR1 O14842 2/20 0.48
ACE2 Q9BYF1 1/20 0.44
SLC1A3 P43003 1/20 0.42
SLC1A2 P43004 1/20 0.42
SLC1A1 P43005 1/20 0.42
MAPT P10636 1/20 0.42
LCK P06239 1/20 0.42
PPARD Q03181 1/20 0.42
ZDHHC20 Q5W0Z9 1/20 0.42
ZDHHC2 Q9UIJ5 1/20 0.42
ALDH1A1 P00352 1/20 0.41
CHRM1 P11229 1/20 0.41
AKR1A1 P14550 1/20 0.41
CHRM3 P20309 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
ADRA1A P35348 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Undecane SCHEMBL20589952 0.96 GPR84 (0.55) CA2MAPK1GPR84FFAR1ACE2
SCHEMBL5907622 0.93 GPR84 (0.57) GPR84FFAR1ACE2SLC1A2SLC1A1
SCHEMBL8982238 0.91 GPR84 (0.61) GPR84FFAR1ACE2MAPTLCK
SCHEMBL22552773 0.91 GPR84 (0.61) GPR84FFAR1ACE2MAPTLCK
SCHEMBL5171539 0.91 GPR84 (0.61) GPR84FFAR1ACE2MAPTLCK
SCHEMBL9431401 0.91 GPR84 (0.61) GPR84FFAR1ACE2MAPTLCK
SCHEMBL9487795 0.91 GPR84 (0.61) GPR84FFAR1ACE2MAPTLCK
SCHEMBL4269015 0.91 GPR84 (0.61) GPR84FFAR1ACE2MAPTLCK
SCHEMBL5907640 0.91 GPR84 (0.61) GPR84FFAR1ACE2MAPTLCK
SCHEMBL9485889 0.91 GPR84 (0.61) GPR84FFAR1ACE2MAPTLCK

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 127 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12532886-B2 Method of killing microbes using C3-C5 n-alkyl-gamma-butyrolactams and antimicrobial compositions containing same VIROX TECHNOLOGIES INC. (CA) 2026-01-27 US claimed
US-12446578-B2 Antimicrobial compositions containing peroxyphthalic acid and/or salt thereof VIROX TECHNOLOGIES INC. (CA) 2025-10-21 US claimed
US-12052990-B2 C3-C5 n-alkyl-gamma-butyrolactam containing antimicrobial compositions and methods of using same VIROX TECHNOLOGIES INC. (CA) 2024-08-06 US claimed
US-20230374269-A1 WATER-SOLUBLE COMPOSITION COMPRISING LYSOPHOSPHATIDYLETHANOLAMINE AND HAVING IMPROVED STABILITY, AND METHOD FOR PREPARING THE SAME LG CHEM, LTD. (KR) 2023-11-23 US claimed
WO-2023075664-A1 A DISINFECTANT FILM-FORMING COMPOSITION AND A DRY DISINFECTANT FILM FORMED ON A SURFACE FROM THE FILM FORMING COMPOSITION Rise Research Institutes of Sweden AB (SE) 2023-05-04 WO claimed
US-20220400671-A1 ANTIMICROBIAL COMPOSITIONS CONTAINING PEROXYPHTHALIC ACID AND/OR SALT THEREOF VIROX TECHNOLOGIES INC. (CA) 2022-12-22 US claimed
EP-4102971-A1 ANTIMICROBIAL COMPOSITIONS CONTAINING PEROXYPHTHALIC ACID AND/OR SALT THEREOF Virox Technologies Inc. (CA) 2022-12-21 EP claimed
EP-4098732-A1 A NOVEL MINIMUM BOILING AZEOTROPE OF N-BUTYL-3-HYDROXYBUTYRATE AND N-UNDECANE AND APPLICATION OF THE AZEOTROPE TO SOLVENT CLEANING Eastman Chemical Company (US) 2022-12-07 EP claimed
EP-3638764-B1 A NOVEL MINIMUM BOILING AZEOTROPE OF N-BUTYL-3-HYDROXYBUTYRATE AND N-UNDECANE AND APPLICATION OF THE AZEOTROPE TO SOLVENT CLEANING EASTMAN CHEM CO (US) 2022-05-11 EP claimed
US-20210386066-A1 C3-C5 N-ALKYL-GAMMA-BUTYROLACTAM CONTAINING ANTIMICROBIAL COMPOSITIONS AND METHODS OF USING SAME VIROX TECHNOLOGIES INC. (CA) 2021-12-16 US claimed
WO-2021161148-A1 ANTIMICROBIAL COMPOSITIONS CONTAINING PEROXYPHTHALIC ACID AND/OR SALT THEREOF VIROX TECHNOLOGIES INC. (CA) 2021-08-19 WO claimed
CN-110023470-B Cleaning composition and test method for intake valve deposits 胜牌许可和知识产权有限公司 2021-06-25 CN claimed
CN-110753747-B Novel minimum boiling azeotropes of n-butyl 3-hydroxybutyrate and n-undecane and their use in solvent cleaning 伊士曼化工公司 2021-06-25 CN claimed
EP-3638764-A1 A NOVEL MINIMUM BOILING AZEOTROPE OF N-BUTYL-3-HYDROXYBUTYRATE AND N-UNDECANE AND APPLICATION OF THE AZEOTROPE TO SOLVENT CLEANING Eastman Chemical Company (US) 2020-04-22 EP claimed
CN-110753747-A Novel minimum boiling azeotropes of n-butyl 3-hydroxybutyrate and n-undecane and their use in solvent cleaning 伊士曼化工公司 2020-02-04 CN claimed
US-10233410-B2 Minimum boiling azeotrope of n-butyl-3-hydroxybutyrate and n-undecane and application of the azeotrope to solvent cleaning EASTMAN CHEMICAL COMPANY (US) 2019-03-19 US claimed
US-20180362894-A1 NOVEL MINIMUM BOILING AZEOTROPE OF N-BUTYL-3-HYDROXYBUTYRATE AND N-UNDECANE AND APPLICATION OF THE AZEOTROPE TO SOLVENT CLEANING EASTMAN CHEMICAL COMPANY (US) 2018-12-20 US claimed
WO-2018231689-A1 A NOVEL MINIMUM BOILING AZEOTROPE OF N-BUTYL-3-HYDROXYBUTYRATE AND N-UNDECANE AND APPLICATION OF THE AZEOTROPE TO SOLVENT CLEANING EASTMAN CHEMICAL COMPANY (US) 2018-12-20 WO claimed
CN-101613314-B Preparation method of antihypertensive drug felodipine HEFEI LIFEON PHARMACEUTIAL CO 2011-11-09 CN claimed
CN-101613314-A The preparation method of antihypertensive drug felodipine HEFEI LIFANG MEDICATION CO LTD 2009-12-30 CN claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12532886-B2 Method of killing microbes using C3-C5 n-alkyl-gamma-butyrolactams and antimicrobial compositions containing same C5, C9, C1S CA2 2188/4885MAPK1 3095/4885GPR84 2129/4885
US-12052990-B2 C3-C5 n-alkyl-gamma-butyrolactam containing antimicrobial compositions and methods of using same C5, C1S, C9 CA2 2561/4885MAPK1 3651/4885GPR84 2149/4885
US-20210386066-A1 C3-C5 N-ALKYL-GAMMA-BUTYROLACTAM CONTAINING ANTIMICROBIAL COMPOSITIONS AND METHODS OF USING SAME C5, C1S, C9 CA2 2561/4885MAPK1 3651/4885GPR84 2149/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.